1-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-(4-morpholinoanilino)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-[4-(4-morpholinyl)anilino]-2-oxoethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-keto-2-(4-morpholinoanilino)ethyl]pyridin-1-ium-3-carboxamide Formula: C18H21N4O3+ MolecularWeight: 341.38434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C[N+]3=CC=CC(=C3)C(=O)N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)C[N+]3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C18H20N4O3/c19-18(24)14-2-1-7-21(12-14)13-17(23)20-15-3-5-16(6-4-15)22-8-10-25-11-9-22/h1-7,12H,8-11,13H2,(H2-,19,20,23,24)/p+1